N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide

C11H24N2O2S — CID 61124953

IUPACN-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C11H24N2O2S/c1-2-8-16(14,15)13-11(9-12)10-6-4-3-5-7-10/h10-11,13H,2-9,12H2,1H3
InChIKeyXRQQKVSZWSGYTQ-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.22
Rot. Bonds6

About N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide

N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide (PubChem CID 61124953) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide
PubChem CID61124953
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C11H24N2O2S/c1-2-8-16(14,15)13-11(9-12)10-6-4-3-5-7-10/h10-11,13H,2-9,12H2,1H3
InChIKeyXRQQKVSZWSGYTQ-UHFFFAOYSA-N
XLogP1.22
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclopentylethyl)ethanesulfonamide
CID 106737875
N-(2-amino-1-cyclohexylethyl)methanesulfonamide
CID 61122382
N-(2-amino-1-cyclopentylethyl)-2-methylpentane-1-sulfonamide;hydrochloride
CID 120585319
[2-amino-1-(dipropylsulfamoylamino)ethyl]cyclohexane
CID 115309320
N-(2-amino-1-cyclohexylethyl)cyclopropanesulfonamide
CID 64553648
N-(2-amino-1-cyclopentylethyl)prop-2-ene-1-sulfonamide
CID 106737824
N-(2-amino-1-cyclopentylethyl)-1-cyanomethanesulfonamide
CID 106737773
N-(2-amino-1-cyclohexylethyl)benzenesulfonamide
CID 61122381
[2-amino-1-[[2-methoxyethyl(methyl)sulfamoyl]amino]ethyl]cyclohexane
CID 119983804
N-(2-amino-1-cyclohexylethyl)-3,5-difluorobenzenesulfonamide
CID 115309326
N-(2-amino-1-cyclopentylethyl)-1-(oxan-2-yl)methanesulfonamide;hydrochloride
CID 120584818
N-(2-amino-1-cyclopropylethyl)-4,4,4-trifluorobutane-1-sulfonamide
CID 83067717

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide (CID 61124953) is N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide is CCCS(=O)(=O)NC(CN)C1CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide?
The InChIKey is XRQQKVSZWSGYTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-2-8-16(14,15)13-11(9-12)10-6-4-3-5-7-10/h10-11,13H,2-9,12H2,1H3.
What are the key properties of N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide?
N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide has a molecular weight of 248.39 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)propane-1-sulfonamide is sourced from PubChem (CID 61124953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).